N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide

C17H20N2O3 — CID 7293095

IUPACN-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide
SMILESCn1ccc2c(OCC(=O)NC3CCCC3)cccc2c1=O
InChIInChI=1S/C17H20N2O3/c1-19-10-9-13-14(17(19)21)7-4-8-15(13)22-11-16(20)18-12-5-2-3-6-12/h4,7-10,12H,2-3,5-6,11H2,1H3,(H,18,20)
InChIKeyINGUAUCVBUEVSG-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.98
Rot. Bonds4

About N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide

N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide (PubChem CID 7293095) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide
PubChem CID7293095
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC NameN-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide
SMILESCn1ccc2c(OCC(=O)NC3CCCC3)cccc2c1=O
InChIInChI=1S/C17H20N2O3/c1-19-10-9-13-14(17(19)21)7-4-8-15(13)22-11-16(20)18-12-5-2-3-6-12/h4,7-10,12H,2-3,5-6,11H2,1H3,(H,18,20)
InChIKeyINGUAUCVBUEVSG-UHFFFAOYSA-N
XLogP1.98
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopentyl-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide
CID 7293273
N-cyclohexyl-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide
CID 43985294
2-(2-methyl-1-oxoisoquinolin-5-yl)oxy-N-phenylacetamide
CID 7293077
2-methyl-5-(2-oxopropoxy)isoquinolin-1-one
CID 43985489
2-(2-methyl-1-oxoisoquinolin-5-yl)oxy-N-(4-methylphenyl)acetamide
CID 43985187
N-[(2-chlorophenyl)methyl]-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide
CID 7293123
ethyl 2-[[2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetyl]amino]acetate
CID 43985195
N-cyclooctyl-2-[1-(2-methoxyethyl)indol-4-yl]oxyacetamide
CID 121239263
N-(5-methyl-1,2-oxazol-3-yl)-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide
CID 7293099
N-(3,4-dichlorophenyl)-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide
CID 7293114
N-cyclohexyl-2-(2-propan-2-ylphenoxy)acetamide
CID 725880
N-[(3R)-1,1-dioxothiolan-3-yl]-2-(1-methylindol-4-yl)oxyacetamide
CID 124878602

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide?
The IUPAC name of N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide (CID 7293095) is N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide.
What is the SMILES notation for N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide?
The canonical SMILES for N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide is Cn1ccc2c(OCC(=O)NC3CCCC3)cccc2c1=O.
What is the InChIKey of N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide?
The InChIKey is INGUAUCVBUEVSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-19-10-9-13-14(17(19)21)7-4-8-15(13)22-11-16(20)18-12-5-2-3-6-12/h4,7-10,12H,2-3,5-6,11H2,1H3,(H,18,20).
What are the key properties of N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide?
N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide has a molecular weight of 300.36 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(2-methyl-1-oxoisoquinolin-5-yl)oxyacetamide is sourced from PubChem (CID 7293095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).